ethyl 3-[4-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]phenyl]pyridine-4-carboxylate

Systemtic Name: ethyl 3-[4-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]phenyl]pyridine-4-carboxylate Openeye Name: ethyl 3-[4-[(2-butyl-4-chloro-5-formyl-imidazol-1-yl)methyl]phenyl]pyridine-4-carboxylate CAS Name: 3-[4-[(2-butyl-4-chloro-5-formyl-1-imidazolyl)methyl]phenyl]-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-[(2-butyl-4-chloro-5-formylimidazol-1-yl)methyl]phenyl]pyridine-4-carboxylate Traditional Name: 3-[4-[(2-butyl-4-chloro-5-formyl-imidazol-1-yl)methyl]phenyl]isonicotinic acid ethyl ester Formula: C23H24ClN3O3 MolecularWeight: 425.90796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=C(C=CN=C3)C(=O)OCC)C=O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=C(C=CN=C3)C(=O)OCC)C=O)Cl

InChI

InChI=1S/C23H24ClN3O3/c1-3-5-6-21-26-22(24)20(15-28)27(21)14-16-7-9-17(10-8-16)19-13-25-12-11-18(19)23(29)30-4-2/h7-13,15H,3-6,14H2,1-2H3